SCHEMBL18357957

SCHEMBL18357957

CN(CCCCS(=O)(=O)O)CCOCCOCCOCCOCCI

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.36
▸ SLC6A4 P31645 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18357922 0.86 LTA4H (0.37) LTA4HSLC6A4
SCHEMBL16790489 0.79 LTA4H (0.39) LTA4HSLC6A4
SCHEMBL18357520 0.77 KDM4E (0.35) —
SCHEMBL14029120 0.75 CA12 (0.41) LTA4H
SCHEMBL14493650 0.73 CA12 (0.38) LTA4H
SCHEMBL18251504 0.73 LTA4H (0.41) LTA4H
SCHEMBL16330497 0.72 S1PR2 (0.44) LTA4H
SCHEMBL18117462 0.72 S1PR2 (0.48) —
SCHEMBL18357514 0.72 LMNA (0.47) SLC6A4
SCHEMBL17058738 0.72 APP (0.38) LTA4H

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2638113-B1 THIOPHENE AZO DYES AND LAUNDRY CARE COMPOSITIONS CONTAINING THE SAME MILLIKEN & CO (US) 2017-01-04 — — EP disclosed
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